1-(1-Benzofuran-2-yl)-2-(1-methyltetrazol-5-yl)sulfanylethanone
TL;DR: 1-(1-Benzofuran-2-yl)-2-(1-methyltetrazol-5-yl)sulfanylethanone (CAS 380185-26-2) is a chemical compound with molecular formula C12H10N4O2S and molecular weight 274.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(1-benzofuran-2-yl)-2-(1-methyltetrazol-5-yl)sulfanylethanone
Also Known As: 1-(1-benzofuran-2-yl)-2-(1-methyltetrazol-5-yl)sulfanylethanone, 1-(benzofuran-2-yl)-2-((1-methyl-1H-tetrazol-5-yl)thio)ethanone, 1-(1-benzofuran-2-yl)-2-[(1-methyl-1H-tetrazol-5-yl)sulfanyl]ethanone
| Molecular Formula | C12H10N4O2S |
|---|---|
| Molecular Weight | 274.05 g/mol |
| LogP | 1.9313 |
| Topological Polar Surface Area | 73.81 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 274.05246 |
| Heavy Atoms | 19 |
| Complexity | 700.99664 |
Chemical Identifiers
| CAS Number | 380185-26-2 |
|---|---|
| SMILES | CN1C(=NN=N1)SCC(=O)C2=CC3=CC=CC=C3O2 |
Product Overview
1-(1-Benzofuran-2-yl)-2-(1-methyltetrazol-5-yl)sulfanylethanone (CAS 380185-26-2), with molecular formula C12H10N4O2S and molecular weight 274.05 g/mol. IUPAC: 1-(1-benzofuran-2-yl)-2-(1-methyltetrazol-5-yl)sulfanylethanone.
Chemical Property Profile of 1-(1-Benzofuran-2-yl)-2-(1-methyltetrazol-5-yl)sulfanylethanone
Property Insights of 1-(1-Benzofuran-2-yl)-2-(1-methyltetrazol-5-yl)sulfanylethanone
The XLogP value of 1.9313 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(1-Benzofuran-2-yl)-2-(1-methyltetrazol-5-yl)sulfanylethanone. The TPSA of 73.81 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(1-Benzofuran-2-yl)-2-(1-methyltetrazol-5-yl)sulfanylethanone. Following Lipinski's Rule of Five, 1-(1-Benzofuran-2-yl)-2-(1-methyltetrazol-5-yl)sulfanylethanone has 0 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 1-(1-Benzofuran-2-yl)-2-(1-methyltetrazol-5-yl)sulfanylethanone?
The CAS number of 1-(1-Benzofuran-2-yl)-2-(1-methyltetrazol-5-yl)sulfanylethanone is 380185-26-2.
What is the molecular formula of 1-(1-Benzofuran-2-yl)-2-(1-methyltetrazol-5-yl)sulfanylethanone?
The molecular formula of 1-(1-Benzofuran-2-yl)-2-(1-methyltetrazol-5-yl)sulfanylethanone is C12H10N4O2S.
What is the molecular weight of 1-(1-Benzofuran-2-yl)-2-(1-methyltetrazol-5-yl)sulfanylethanone?
The molecular weight of 1-(1-Benzofuran-2-yl)-2-(1-methyltetrazol-5-yl)sulfanylethanone is 274.05 g/mol.
Where can I buy 1-(1-Benzofuran-2-yl)-2-(1-methyltetrazol-5-yl)sulfanylethanone?
You can request a quote for 1-(1-Benzofuran-2-yl)-2-(1-methyltetrazol-5-yl)sulfanylethanone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(1-Benzofuran-2-yl)-2-(1-methyltetrazol-5-yl)sulfanylethanone?
Yes, KEHONG BIO provides custom synthesis services for 1-(1-Benzofuran-2-yl)-2-(1-methyltetrazol-5-yl)sulfanylethanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.